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Benzeneethanol,b-methyl-, (bS)-

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Name

Benzeneethanol,b-methyl-, (bS)-

EINECS N/A
CAS No. 37778-99-7 Density 0.994 g/cm3
PSA 20.23000 LogP 1.78240
Solubility N/A Melting Point N/A
Formula C9H12O Boiling Point 232.22 °C at 760 mmHg
Molecular Weight 136.194 Flash Point 77.407 °C
Transport Information N/A Appearance Clear colourless liquid
Safety 23-24/25 Risk Codes 22
Molecular Structure Molecular Structure of 37778-99-7 ((S)-(-)-2-PHENYL-1-PROPANOL) Hazard Symbols HarmfulXn
Synonyms

Benzeneethanol,b-methyl-, (S)-;(-)-2-Phenyl-1-propanol;(-)-2-Phenylpropanol;(-)-b-Methylbenzeneethanol;(2S)-2-Phenylpropan-1-ol;(S)-(-)-2-Phenylpropyl alcohol;(S)-2-Phenyl-1-propanol;2(S)-Phenyl-1-propanol;S-(-)-2-Phenyl-1-propanol;

Article Data 130

Benzeneethanol,b-methyl-, (bS)- Specification

The CAS register number of Benzeneethanol,b-methyl-, (bS)- is 37778-99-7. It also can be called as (S)-2-Phenyl-1-propanol and the systematic name about this chemical is (2S)-2-phenylpropan-1-ol. The molecular formula about this chemical is C9H12O and the molecular weight is 136.19. It belongs to the following product categories which include Alcohols, Hydroxy Esters and Derivatives; Chiral Compounds and so on.

Physical properties about Benzeneethanol,b-methyl-, (bS)- are: (1)ACD/LogP: 1.86; (2)ACD/LogD (pH 5.5): 1.858; (3)ACD/LogD (pH 7.4): 1.858; (4)ACD/BCF (pH 5.5): 15.199; (5)ACD/BCF (pH 7.4): 15.199; (6)ACD/KOC (pH 5.5): 244.102; (7)ACD/KOC (pH 7.4): 244.102; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 20.23 Å2; (12)Index of Refraction: 1.525; (13)Molar Refractivity: 41.973 cm3; (14)Molar Volume: 137.012 cm3; (15)Polarizability: 16.639x10-24cm3; (16)Surface Tension: 37.499 dyne/cm; (17)Density: 0.994 g/cm3; (18)Flash Point: 77.407 °C; (19)Enthalpy of Vaporization: 49.556 kJ/mol; (20)Boiling Point: 232.22 °C at 760 mmHg; (21)Vapour Pressure: 0.033 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful if swallowed and it may cause damage to health. If you want to use it, do not breathe vapour and avoid contact with skin and eyes. It is slightly hazardous to water. It is not permitted undiluted product or large quantities to reach ground water, water course or sewage system. If no official permission, do not put materials into the permission surroundings. If you want to store it, you should keep the container tightly sealed in dry, cool places. Normally it will not be decomposed and there is no dangerous reflect.

You can still convert the following datas into molecular structure:
(1)SMILES: C[C@H](CO)c1ccccc1
(2)InChI: InChI=1/C9H12O/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3/t8-/m1/s1
(3)InChIKey: RNDNSYIPLPAXAZ-MRVPVSSYBN
(4)Std. InChI: InChI=1S/C9H12O/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3/t8-/m1/s1
(5)Std. InChIKey: RNDNSYIPLPAXAZ-MRVPVSSYSA-N

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